Hmdb loader
You are using an unsupported browser. Please upgrade your browser to a newer version to get the best experience on Human Metabolome Database.
Record Information
Version5.0
StatusDetected and Quantified
Creation Date2005-11-16 15:48:42 UTC
Update Date2021-09-14 15:46:58 UTC
HMDB IDHMDB0000854
Secondary Accession Numbers
  • HMDB00854
Metabolite Identification
Common NameFormiminoglutamic acid
DescriptionFormiminoglutamic acid, also known as N-formimino-L-glutamate or formimino-glu, belongs to the class of organic compounds known as glutamic acid and derivatives. Glutamic acid and derivatives are compounds containing glutamic acid or a derivative thereof resulting from reaction of glutamic acid at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom. Formiminoglutamic acid exists in all living organisms, ranging from bacteria to humans. In humans, formiminoglutamic acid is involved in the histidine metabolism pathway. Formiminoglutamic acid has been detected, but not quantified in, a few different foods, such as anatidaes (Anatidae), chickens (Gallus gallus), and domestic pigs (Sus scrofa domestica). This could make formiminoglutamic acid a potential biomarker for the consumption of these foods. Formiminoglutamic acid is a primary metabolite. Primary metabolites are metabolically or physiologically essential metabolites. They are directly involved in an organism’s growth, development or reproduction. Based on a literature review a significant number of articles have been published on Formiminoglutamic acid.
Structure
Data?1582752160
Synonyms
ValueSource
N-Formimidoyl-L-glutamateChEBI
N-Formimino-L-glutamateChEBI
N-Formimidoyl-L-glutamic acidGenerator
N-Formimino-L-glutamic acidGenerator
FormiminoglutamateGenerator
Formimino-gluHMDB
Formimino-L-glutamateHMDB
Formimino-L-glutamic acidHMDB
N-(Iminomethyl)-L-glutamic acidHMDB
N-Formimidoyl-glutamic acidHMDB
N-Formimino-glutamateHMDB
Acid, formiminoglutamicHMDB
FIGLUHMDB
Chemical FormulaC6H10N2O4
Average Molecular Weight174.1546
Monoisotopic Molecular Weight174.064056818
IUPAC Name(2S)-2-methanimidamidopentanedioic acid
Traditional NameN-formimino-L-glutamate
CAS Registry Number816-90-0
SMILES
OC(=O)CC[C@H](NC=N)C(O)=O
InChI Identifier
InChI=1S/C6H10N2O4/c7-3-8-4(6(11)12)1-2-5(9)10/h3-4H,1-2H2,(H2,7,8)(H,9,10)(H,11,12)/t4-/m0/s1
InChI KeyNRXIKWMTVXPVEF-BYPYZUCNSA-N
Chemical Taxonomy
Description Belongs to the class of organic compounds known as glutamic acid and derivatives. Glutamic acid and derivatives are compounds containing glutamic acid or a derivative thereof resulting from reaction of glutamic acid at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
KingdomOrganic compounds
Super ClassOrganic acids and derivatives
ClassCarboxylic acids and derivatives
Sub ClassAmino acids, peptides, and analogues
Direct ParentGlutamic acid and derivatives
Alternative Parents
Substituents
  • Glutamic acid or derivatives
  • Dicarboxylic acid or derivatives
  • Fatty acid
  • Amidine
  • Carboxylic acid amidine
  • Carboxylic acid
  • Carboximidamide
  • Propargyl-type 1,3-dipolar organic compound
  • Organic 1,3-dipolar compound
  • Formamidine
  • Organooxygen compound
  • Carbonyl group
  • Organic nitrogen compound
  • Organonitrogen compound
  • Hydrocarbon derivative
  • Organic oxygen compound
  • Organic oxide
  • Organopnictogen compound
  • Aliphatic acyclic compound
Molecular FrameworkAliphatic acyclic compounds
External Descriptors
Ontology
Physiological effect

Adverse health effect

Disposition

Biological location

Source

Process

Naturally occurring process

Physical Properties
StateSolid
Experimental Molecular Properties
PropertyValueReference
Melting PointNot AvailableNot Available
Boiling PointNot AvailableNot Available
Water SolubilityNot AvailableNot Available
LogPNot AvailableNot Available
Experimental Chromatographic PropertiesNot Available
Predicted Molecular Properties
PropertyValueSource
Water Solubility2.28 g/LALOGPS
logP-1.3ALOGPS
logP-2.8ChemAxon
logS-1.9ALOGPS
pKa (Strongest Acidic)2.49ChemAxon
pKa (Strongest Basic)10.88ChemAxon
Physiological Charge-1ChemAxon
Hydrogen Acceptor Count6ChemAxon
Hydrogen Donor Count4ChemAxon
Polar Surface Area110.48 ŲChemAxon
Rotatable Bond Count5ChemAxon
Refractivity48.71 m³·mol⁻¹ChemAxon
Polarizability15.61 ųChemAxon
Number of Rings0ChemAxon
BioavailabilityYesChemAxon
Rule of FiveYesChemAxon
Ghose FilterNoChemAxon
Veber's RuleNoChemAxon
MDDR-like RuleNoChemAxon
Predicted Chromatographic Properties

Predicted Collision Cross Sections

PredictorAdduct TypeCCS Value (Å2)Reference
DarkChem[M+H]+139.94431661259
DarkChem[M-H]-136.03131661259
AllCCS[M+H]+139.23932859911
AllCCS[M-H]-133.32532859911
DeepCCS[M+H]+133.42430932474
DeepCCS[M-H]-129.63330932474
DeepCCS[M-2H]-167.12130932474
DeepCCS[M+Na]+142.6630932474

Predicted Kovats Retention Indices

Underivatized

MetaboliteSMILESKovats RI ValueColumn TypeReference
Formiminoglutamic acidOC(=O)CC[C@H](NC=N)C(O)=O2967.9Standard polar33892256
Formiminoglutamic acidOC(=O)CC[C@H](NC=N)C(O)=O1605.3Standard non polar33892256
Formiminoglutamic acidOC(=O)CC[C@H](NC=N)C(O)=O1882.4Semi standard non polar33892256

Derivatized

Derivative Name / StructureSMILESKovats RI ValueColumn TypeReference
Formiminoglutamic acid,1TMS,isomer #1C[Si](C)(C)OC(=O)CC[C@H](NC=N)C(=O)O1801.7Semi standard non polar33892256
Formiminoglutamic acid,1TMS,isomer #2C[Si](C)(C)OC(=O)[C@H](CCC(=O)O)NC=N1762.5Semi standard non polar33892256
Formiminoglutamic acid,1TMS,isomer #3C[Si](C)(C)N(C=N)[C@@H](CCC(=O)O)C(=O)O1875.6Semi standard non polar33892256
Formiminoglutamic acid,1TMS,isomer #4C[Si](C)(C)N=CN[C@@H](CCC(=O)O)C(=O)O1813.9Semi standard non polar33892256
Formiminoglutamic acid,2TMS,isomer #1C[Si](C)(C)OC(=O)CC[C@H](NC=N)C(=O)O[Si](C)(C)C1821.6Semi standard non polar33892256
Formiminoglutamic acid,2TMS,isomer #2C[Si](C)(C)OC(=O)CC[C@@H](C(=O)O)N(C=N)[Si](C)(C)C1904.4Semi standard non polar33892256
Formiminoglutamic acid,2TMS,isomer #3C[Si](C)(C)N=CN[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O1818.3Semi standard non polar33892256
Formiminoglutamic acid,2TMS,isomer #4C[Si](C)(C)OC(=O)[C@H](CCC(=O)O)N(C=N)[Si](C)(C)C1903.3Semi standard non polar33892256
Formiminoglutamic acid,2TMS,isomer #5C[Si](C)(C)N=CN[C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C1815.7Semi standard non polar33892256
Formiminoglutamic acid,2TMS,isomer #6C[Si](C)(C)N=CN([C@@H](CCC(=O)O)C(=O)O)[Si](C)(C)C1910.8Semi standard non polar33892256
Formiminoglutamic acid,3TMS,isomer #1C[Si](C)(C)OC(=O)CC[C@@H](C(=O)O[Si](C)(C)C)N(C=N)[Si](C)(C)C1911.4Semi standard non polar33892256
Formiminoglutamic acid,3TMS,isomer #1C[Si](C)(C)OC(=O)CC[C@@H](C(=O)O[Si](C)(C)C)N(C=N)[Si](C)(C)C1840.3Standard non polar33892256
Formiminoglutamic acid,3TMS,isomer #1C[Si](C)(C)OC(=O)CC[C@@H](C(=O)O[Si](C)(C)C)N(C=N)[Si](C)(C)C2412.8Standard polar33892256
Formiminoglutamic acid,3TMS,isomer #2C[Si](C)(C)N=CN[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C1849.1Semi standard non polar33892256
Formiminoglutamic acid,3TMS,isomer #2C[Si](C)(C)N=CN[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C1683.3Standard non polar33892256
Formiminoglutamic acid,3TMS,isomer #2C[Si](C)(C)N=CN[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C2671.5Standard polar33892256
Formiminoglutamic acid,3TMS,isomer #3C[Si](C)(C)N=CN([C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O)[Si](C)(C)C1901.7Semi standard non polar33892256
Formiminoglutamic acid,3TMS,isomer #3C[Si](C)(C)N=CN([C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O)[Si](C)(C)C1879.7Standard non polar33892256
Formiminoglutamic acid,3TMS,isomer #3C[Si](C)(C)N=CN([C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O)[Si](C)(C)C2487.8Standard polar33892256
Formiminoglutamic acid,3TMS,isomer #4C[Si](C)(C)N=CN([C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C)[Si](C)(C)C1920.8Semi standard non polar33892256
Formiminoglutamic acid,3TMS,isomer #4C[Si](C)(C)N=CN([C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C)[Si](C)(C)C1855.2Standard non polar33892256
Formiminoglutamic acid,3TMS,isomer #4C[Si](C)(C)N=CN([C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C)[Si](C)(C)C2473.5Standard polar33892256
Formiminoglutamic acid,4TMS,isomer #1C[Si](C)(C)N=CN([C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C1931.2Semi standard non polar33892256
Formiminoglutamic acid,4TMS,isomer #1C[Si](C)(C)N=CN([C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C1860.7Standard non polar33892256
Formiminoglutamic acid,4TMS,isomer #1C[Si](C)(C)N=CN([C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C2236.6Standard polar33892256
Formiminoglutamic acid,1TBDMS,isomer #1CC(C)(C)[Si](C)(C)OC(=O)CC[C@H](NC=N)C(=O)O2054.0Semi standard non polar33892256
Formiminoglutamic acid,1TBDMS,isomer #2CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCC(=O)O)NC=N2029.1Semi standard non polar33892256
Formiminoglutamic acid,1TBDMS,isomer #3CC(C)(C)[Si](C)(C)N(C=N)[C@@H](CCC(=O)O)C(=O)O2098.6Semi standard non polar33892256
Formiminoglutamic acid,1TBDMS,isomer #4CC(C)(C)[Si](C)(C)N=CN[C@@H](CCC(=O)O)C(=O)O2060.5Semi standard non polar33892256
Formiminoglutamic acid,2TBDMS,isomer #1CC(C)(C)[Si](C)(C)OC(=O)CC[C@H](NC=N)C(=O)O[Si](C)(C)C(C)(C)C2253.9Semi standard non polar33892256
Formiminoglutamic acid,2TBDMS,isomer #2CC(C)(C)[Si](C)(C)OC(=O)CC[C@@H](C(=O)O)N(C=N)[Si](C)(C)C(C)(C)C2369.1Semi standard non polar33892256
Formiminoglutamic acid,2TBDMS,isomer #3CC(C)(C)[Si](C)(C)N=CN[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O2268.2Semi standard non polar33892256
Formiminoglutamic acid,2TBDMS,isomer #4CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCC(=O)O)N(C=N)[Si](C)(C)C(C)(C)C2348.3Semi standard non polar33892256
Formiminoglutamic acid,2TBDMS,isomer #5CC(C)(C)[Si](C)(C)N=CN[C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C(C)(C)C2246.1Semi standard non polar33892256
Formiminoglutamic acid,2TBDMS,isomer #6CC(C)(C)[Si](C)(C)N=CN([C@@H](CCC(=O)O)C(=O)O)[Si](C)(C)C(C)(C)C2309.9Semi standard non polar33892256
Formiminoglutamic acid,3TBDMS,isomer #1CC(C)(C)[Si](C)(C)OC(=O)CC[C@@H](C(=O)O[Si](C)(C)C(C)(C)C)N(C=N)[Si](C)(C)C(C)(C)C2544.5Semi standard non polar33892256
Formiminoglutamic acid,3TBDMS,isomer #1CC(C)(C)[Si](C)(C)OC(=O)CC[C@@H](C(=O)O[Si](C)(C)C(C)(C)C)N(C=N)[Si](C)(C)C(C)(C)C2460.0Standard non polar33892256
Formiminoglutamic acid,3TBDMS,isomer #1CC(C)(C)[Si](C)(C)OC(=O)CC[C@@H](C(=O)O[Si](C)(C)C(C)(C)C)N(C=N)[Si](C)(C)C(C)(C)C2624.8Standard polar33892256
Formiminoglutamic acid,3TBDMS,isomer #2CC(C)(C)[Si](C)(C)N=CN[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C2449.9Semi standard non polar33892256
Formiminoglutamic acid,3TBDMS,isomer #2CC(C)(C)[Si](C)(C)N=CN[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C2280.4Standard non polar33892256
Formiminoglutamic acid,3TBDMS,isomer #2CC(C)(C)[Si](C)(C)N=CN[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C2721.0Standard polar33892256
Formiminoglutamic acid,3TBDMS,isomer #3CC(C)(C)[Si](C)(C)N=CN([C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O)[Si](C)(C)C(C)(C)C2539.5Semi standard non polar33892256
Formiminoglutamic acid,3TBDMS,isomer #3CC(C)(C)[Si](C)(C)N=CN([C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O)[Si](C)(C)C(C)(C)C2379.9Standard non polar33892256
Formiminoglutamic acid,3TBDMS,isomer #3CC(C)(C)[Si](C)(C)N=CN([C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O)[Si](C)(C)C(C)(C)C2671.2Standard polar33892256
Formiminoglutamic acid,3TBDMS,isomer #4CC(C)(C)[Si](C)(C)N=CN([C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2535.2Semi standard non polar33892256
Formiminoglutamic acid,3TBDMS,isomer #4CC(C)(C)[Si](C)(C)N=CN([C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2366.3Standard non polar33892256
Formiminoglutamic acid,3TBDMS,isomer #4CC(C)(C)[Si](C)(C)N=CN([C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2662.3Standard polar33892256
Formiminoglutamic acid,4TBDMS,isomer #1CC(C)(C)[Si](C)(C)N=CN([C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2745.5Semi standard non polar33892256
Formiminoglutamic acid,4TBDMS,isomer #1CC(C)(C)[Si](C)(C)N=CN([C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2551.9Standard non polar33892256
Formiminoglutamic acid,4TBDMS,isomer #1CC(C)(C)[Si](C)(C)N=CN([C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2588.2Standard polar33892256
Spectra

GC-MS Spectra

Spectrum TypeDescriptionSplash KeyDeposition DateSourceView
Predicted GC-MSPredicted GC-MS Spectrum - Formiminoglutamic acid GC-MS (Non-derivatized) - 70eV, Positivesplash10-056u-9400000000-6cceb3db80c1c51b57982017-09-01Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Formiminoglutamic acid GC-MS (2 TMS) - 70eV, Positivesplash10-0fg9-9230000000-65123e05e539b5af23882017-10-06Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Formiminoglutamic acid GC-MS (Non-derivatized) - 70eV, PositiveNot Available2021-10-12Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Formiminoglutamic acid GC-MS (TMS_1_1) - 70eV, PositiveNot Available2021-11-06Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Formiminoglutamic acid GC-MS (TMS_1_2) - 70eV, PositiveNot Available2021-11-06Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Formiminoglutamic acid GC-MS (TMS_1_3) - 70eV, PositiveNot Available2021-11-06Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Formiminoglutamic acid GC-MS (TMS_1_4) - 70eV, PositiveNot Available2021-11-06Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Formiminoglutamic acid GC-MS (TMS_2_2) - 70eV, PositiveNot Available2021-11-06Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Formiminoglutamic acid GC-MS (TMS_2_3) - 70eV, PositiveNot Available2021-11-06Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Formiminoglutamic acid GC-MS (TMS_2_4) - 70eV, PositiveNot Available2021-11-06Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Formiminoglutamic acid GC-MS (TMS_2_5) - 70eV, PositiveNot Available2021-11-06Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Formiminoglutamic acid GC-MS (TMS_2_6) - 70eV, PositiveNot Available2021-11-06Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Formiminoglutamic acid GC-MS (TBDMS_1_1) - 70eV, PositiveNot Available2021-11-06Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Formiminoglutamic acid GC-MS (TBDMS_1_2) - 70eV, PositiveNot Available2021-11-06Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Formiminoglutamic acid GC-MS (TBDMS_1_3) - 70eV, PositiveNot Available2021-11-06Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Formiminoglutamic acid GC-MS (TBDMS_1_4) - 70eV, PositiveNot Available2021-11-06Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Formiminoglutamic acid GC-MS (TBDMS_2_1) - 70eV, PositiveNot Available2021-11-06Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Formiminoglutamic acid GC-MS (TBDMS_2_2) - 70eV, PositiveNot Available2021-11-06Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Formiminoglutamic acid GC-MS (TBDMS_2_3) - 70eV, PositiveNot Available2021-11-06Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Formiminoglutamic acid GC-MS (TBDMS_2_4) - 70eV, PositiveNot Available2021-11-06Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Formiminoglutamic acid GC-MS (TBDMS_2_5) - 70eV, PositiveNot Available2021-11-06Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Formiminoglutamic acid GC-MS (TBDMS_2_6) - 70eV, PositiveNot Available2021-11-06Wishart LabView Spectrum

MS/MS Spectra

Spectrum TypeDescriptionSplash KeyDeposition DateSourceView
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Formiminoglutamic acid 10V, Positive-QTOFsplash10-056r-0900000000-92c0f47c419298fb78a22016-08-03Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Formiminoglutamic acid 20V, Positive-QTOFsplash10-004j-5900000000-8b915dd10756167a40032016-08-03Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Formiminoglutamic acid 40V, Positive-QTOFsplash10-0012-9100000000-313b0983e834934e56822016-08-03Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Formiminoglutamic acid 10V, Negative-QTOFsplash10-00fr-1900000000-b264a846efb94105ac492016-08-04Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Formiminoglutamic acid 20V, Negative-QTOFsplash10-0f97-5900000000-2f4ec838a8ef46f9428d2016-08-04Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Formiminoglutamic acid 40V, Negative-QTOFsplash10-002f-9200000000-a518077a6ec2f6a6c6c52016-08-04Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Formiminoglutamic acid 10V, Positive-QTOFsplash10-004i-0900000000-e21825a4085307dba5012021-09-23Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Formiminoglutamic acid 20V, Positive-QTOFsplash10-02d0-7900000000-39bddd8ed9efae999a7c2021-09-23Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Formiminoglutamic acid 40V, Positive-QTOFsplash10-0015-9000000000-8230ed13a5a7ee4c82a62021-09-23Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Formiminoglutamic acid 10V, Negative-QTOFsplash10-00b9-0900000000-d26547339916cbc25d342021-09-25Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Formiminoglutamic acid 20V, Negative-QTOFsplash10-0773-9700000000-d2b6c121d8ab7a8500b72021-09-25Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Formiminoglutamic acid 40V, Negative-QTOFsplash10-0006-9100000000-abb21e9862307446d7ec2021-09-25Wishart LabView Spectrum

NMR Spectra

Spectrum TypeDescriptionDeposition DateSourceView
Predicted 1D NMR1H NMR Spectrum (1D, 100 MHz, D2O, predicted)2021-09-16Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 100 MHz, D2O, predicted)2021-09-16Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 200 MHz, D2O, predicted)2021-09-16Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 200 MHz, D2O, predicted)2021-09-16Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 300 MHz, D2O, predicted)2021-09-16Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 300 MHz, D2O, predicted)2021-09-16Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 400 MHz, D2O, predicted)2021-09-16Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 400 MHz, D2O, predicted)2021-09-16Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 500 MHz, D2O, predicted)2021-09-16Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 500 MHz, D2O, predicted)2021-09-16Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 600 MHz, D2O, predicted)2021-09-16Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 600 MHz, D2O, predicted)2021-09-16Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 700 MHz, D2O, predicted)2021-09-16Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 700 MHz, D2O, predicted)2021-09-16Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 800 MHz, D2O, predicted)2021-09-16Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 800 MHz, D2O, predicted)2021-09-16Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 900 MHz, D2O, predicted)2021-09-16Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 900 MHz, D2O, predicted)2021-09-16Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 1000 MHz, D2O, predicted)2021-09-16Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 1000 MHz, D2O, predicted)2021-09-16Wishart LabView Spectrum
Biological Properties
Cellular Locations
  • Cytoplasm
Biospecimen Locations
  • Feces
  • Urine
Tissue LocationsNot Available
Pathways
Normal Concentrations
BiospecimenStatusValueAgeSexConditionReferenceDetails
FecesDetected but not QuantifiedNot QuantifiedAdult (>18 years old)Both
Normal
details
FecesDetected but not QuantifiedNot QuantifiedAdult (>18 years old)Both
Normal
details
UrineDetected and Quantified13.400-21.800 umol/mmol creatinineAdult (>18 years old)Both
Normal
details
UrineDetected and Quantified0.47 (0.0-0.80) umol/mmol creatinineAdult (>18 years old)BothNormal
    • Geigy Scientific ...
    • West Cadwell, N.J...
    • Basel, Switzerlan...
details
UrineDetected and Quantified0.90 +/- 0.71 umol/mmol creatinineInfant (0-1 year old)BothNormal details
Abnormal Concentrations
BiospecimenStatusValueAgeSexConditionReferenceDetails
FecesDetected but not QuantifiedNot QuantifiedAdult (>18 years old)BothColorectal Cancer details
UrineDetected and Quantified780.114-1876.796 umol/mmol creatinineChildren (1-13 years old)BothGlutamate formiminotransferase deficiency details
Associated Disorders and Diseases
Disease References
Colorectal cancer
  1. Brown DG, Rao S, Weir TL, O'Malia J, Bazan M, Brown RJ, Ryan EP: Metabolomics and metabolic pathway networks from human colorectal cancers, adjacent mucosa, and stool. Cancer Metab. 2016 Jun 6;4:11. doi: 10.1186/s40170-016-0151-y. eCollection 2016. [PubMed:27275383 ]
Glutamate formiminotransferase deficiency
  1. Perry TL, Applegarth DA, Evans ME, Hansen S, Jellum E: Metabolic studies of a family with massive formiminoglutamic aciduria. Pediatr Res. 1975 Mar;9(3):117-22. [PubMed:235753 ]
Associated OMIM IDs
  • 114500 (Colorectal cancer)
  • 229100 (Glutamate formiminotransferase deficiency)
DrugBank IDNot Available
Phenol Explorer Compound IDNot Available
FooDB IDFDB022280
KNApSAcK IDNot Available
Chemspider ID388370
KEGG Compound IDC00439
BioCyc IDN-FORMIMINO-L-GLUTAMATE
BiGG ID34986
Wikipedia LinkFormiminoglutamic acid
METLIN ID5817
PubChem Compound439233
PDB IDNot Available
ChEBI ID7274
Food Biomarker OntologyNot Available
VMH IDFORGLU
MarkerDB IDNot Available
Good Scents IDNot Available
References
Synthesis ReferenceTabor, Herbert; Rabinowitz, Jesse C. Insts. Formiminoglycine, formimino-L-aspartic acid, and formimino-L-glutamic acid.
Material Safety Data Sheet (MSDS)Not Available
General References
  1. Hilton JF, Christensen KE, Watkins D, Raby BA, Renaud Y, de la Luna S, Estivill X, MacKenzie RE, Hudson TJ, Rosenblatt DS: The molecular basis of glutamate formiminotransferase deficiency. Hum Mutat. 2003 Jul;22(1):67-73. [PubMed:12815595 ]
  2. Haurani FI, Hall CA, Rubin R: Megaloblastic anemia as a result of an abnormal transcobalamin II (Cardeza). J Clin Invest. 1979 Nov;64(5):1253-9. [PubMed:500809 ]
  3. Perry TL, Applegarth DA, Evans ME, Hansen S, Jellum E: Metabolic studies of a family with massive formiminoglutamic aciduria. Pediatr Res. 1975 Mar;9(3):117-22. [PubMed:235753 ]
  4. Verhoeven NM, Wanders RJ, Poll-The BT, Saudubray JM, Jakobs C: The metabolism of phytanic acid and pristanic acid in man: a review. J Inherit Metab Dis. 1998 Oct;21(7):697-728. [PubMed:9819701 ]

Enzymes

General function:
Involved in catalytic activity
Specific function:
Folate-dependent enzyme, that displays both transferase and deaminase activity. Serves to channel one-carbon units from formiminoglutamate to the folate pool. Binds and promotes bundling of vimentin filaments originating from the Golgi (By similarity).
Gene Name:
FTCD
Uniprot ID:
O95954
Molecular weight:
58925.93
Reactions
5-Formiminotetrahydrofolic acid + L-Glutamic acid → Tetrahydrofolic acid + Formiminoglutamic aciddetails
5-Formiminotetrahydrofolic acid + L-Glutamic acid → Tetrahydrofolic acid + Formiminoglutamic aciddetails
General function:
Involved in hydrolase activity, acting on carbon-nitrogen (but not peptide) bonds, in cyclic amides
Specific function:
Not Available
Gene Name:
AMDHD1
Uniprot ID:
Q96NU7
Molecular weight:
46742.505
Reactions
4-Imidazolone-5-propionic acid + Water → Formiminoglutamic acid + Hydrogen Iondetails
4-Imidazolone-5-propionic acid + Water → Formiminoglutamic aciddetails